Geometry & MOs

Info

ID:	175939
PubChem CID:	75970488
Reduced:	O21N37C98H177 (1)
Stoich.:	A21B37C98D177 (1)
Weight, g/mol:	2182.401036
ΔH_f, kcal/mol:	-1029.07
Dipole, Da:	9.04
IP(EA), eV:	-9.13(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

CCC(C)C(C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)NC(CCC(=O)N)C(=O)NC(C)C(=O)NC(CC1=CN=CN1)C(=O)NC(C)C(=O)NC(CC2=CN=CN2)C(=O)NC(CO)C(=O)NC(CCCCN)C(=O)O)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CC(C)C)NC(=O)C(C(C)CC)NC(=O)C(C(C)CC)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)N

DOS

IR

Vibrations