Geometry & MOs

Info

ID:	433739
PubChem CID:	135173880
Reduced:	O6N7H41C43 (1)
Stoich.:	A6B7C41D43 (1)
Weight, g/mol:	196.092186
ΔH_f, kcal/mol:	-97.02
Dipole, Da:	6.48
IP(EA), eV:	-8.62(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCCCN4CCN(CC4)C5=CC=C(C=C5)N6C=C(C(=N6)C7=CC=NC=C7)C8=CC9=C(C=C8)C(CC9)O

DOS

IR

Vibrations