Geometry & MOs

Info

ID:	72277
PubChem CID:	48415997
Reduced:	FON4H21C22 (1)
Stoich.:	ABC4D21E22 (1)
Weight, g/mol:	357.125946
ΔH_f, kcal/mol:	-8.56
Dipole, Da:	6.41
IP(EA), eV:	-9.15(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C=CC(=CC2=N1)F)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations