Geometry & MOs

Info

ID:	72270
PubChem CID:	48415990
Reduced:	N3O3C23H27 (1)
Stoich.:	A3B3C23D27 (1)
Weight, g/mol:	314.120132
ΔH_f, kcal/mol:	-81.51
Dipole, Da:	8.65
IP(EA), eV:	-9.18(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N,4-dimethyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations