Geometry & MOs

Info

ID:	185222
PubChem CID:	77272099
Reduced:	O3N7C28H35 (1)
Stoich.:	A3B7C28D35 (1)
Weight, g/mol:	543.299005
ΔH_f, kcal/mol:	-45.77
Dipole, Da:	4.69
IP(EA), eV:	-8.82(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC2=CN=C(N=C2N1C3CCCCCC3)NC4=NC=C(C=C4)C(=O)N5CC6CCC5C6O

DOS

IR

Vibrations