Geometry & MOs

Info

ID:	240025
PubChem CID:	93575822
Reduced:	O3N4C20H30 (1)
Stoich.:	A3B4C20D30 (1)
Weight, g/mol:	404.221226
ΔH_f, kcal/mol:	-117.81
Dipole, Da:	3.67
IP(EA), eV:	-8.84(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]-2-methylpropanamide

Drug info:

PubChemData

Smile

CCOCCCNC(=O)CN1C2=CC=CC=C2N=C1[C@@H](C)NC(=O)C(C)C

DOS

IR

Vibrations