Geometry & MOs

Info

ID:	56987
PubChem CID:	22395186
Reduced:	N13O13C47H75 (1)
Stoich.:	A13B13C47D75 (1)
Weight, g/mol:	2019.116892
ΔH_f, kcal/mol:	-612.88
Dipole, Da:	3.28
IP(EA), eV:	-8.82(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC(C(C)O)C(=O)O)NC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(=O)N)NC(=O)C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(CCC(=O)O)N

DOS

IR

Vibrations