Geometry & MOs

Info

ID:	175645
PubChem CID:	75930412
Reduced:	SCl2O2N6C18H20 (1)
Stoich.:	AB2C2D6E18F20 (1)
Weight, g/mol:	360.135304
ΔH_f, kcal/mol:	-15.9
Dipole, Da:	1.3
IP(EA), eV:	-9.0(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-1-methylbenzimidazol-2-yl)-1-(cyclopropanecarbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(OC1)CN2C(=NN=C2SCC3=CN4C=C(C=C(C4=N3)Cl)Cl)CCC(=O)N

DOS

IR

Vibrations