Geometry & MOs

Info

ID:	290920
PubChem CID:	111639772
Reduced:	ClON4C22H27 (1)
Stoich.:	ABC4D22E27 (1)
Weight, g/mol:	413.198238
ΔH_f, kcal/mol:	20.55
Dipole, Da:	3.97
IP(EA), eV:	-9.18(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[N-[[1-(3-chlorophenyl)cyclopropyl]methyl]-N'-methylcarbamimidoyl]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide

Drug info:

PubChemData

Smile

CCNC(=O)C1=CC=CC(=C1)CNC(=NC)NCC2(CC2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations