Geometry & MOs

Info

ID:	72056
PubChem CID:	48415763
Reduced:	SO2N4H22C23 (1)
Stoich.:	AB2C4D22E23 (1)
Weight, g/mol:	360.169859
ΔH_f, kcal/mol:	9.61
Dipole, Da:	1.26
IP(EA), eV:	-8.99(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-6-pyrazol-1-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CS4

DOS

IR

Vibrations