Geometry & MOs

Info

ID:	71900
PubChem CID:	48415597
Reduced:	O2N5C23H29 (1)
Stoich.:	A2B5C23D29 (1)
Weight, g/mol:	408.142011
ΔH_f, kcal/mol:	-44.09
Dipole, Da:	4.76
IP(EA), eV:	-9.35(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations