Geometry & MOs

Info

ID:	440279
PubChem CID:	135230224
Reduced:	SN7C21H29 (1)
Stoich.:	AB7C21D29 (1)
Weight, g/mol:	440.093456
ΔH_f, kcal/mol:	125.44
Dipole, Da:	2.9
IP(EA), eV:	-8.58(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[[4-chloro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]pyridin-2-yl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CCCC(=C)NC1=CC=CC(=N1)CSCN(C2=CC=CC=C2N=C)C(=N)N(C)N

DOS

IR

Vibrations