Geometry & MOs

Info

ID:	71807
PubChem CID:	48415463
Reduced:	SO2N4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	376.169939
ΔH_f, kcal/mol:	-44.86
Dipole, Da:	1.23
IP(EA), eV:	-8.88(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-7-fluoro-N,2-dimethylquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=O)N1CCC(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations