Geometry & MOs

Info

ID:	142999
PubChem CID:	53131114
Reduced:	ClO2N6H15C21 (1)
Stoich.:	AB2C6D15E21 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	109.95
Dipole, Da:	3.55
IP(EA), eV:	-9.35(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyphenyl)-3-(2-propan-2-yl-3H-benzimidazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)CN3C(=O)C4=CC(=NN4C=N3)C5=CC=CC=C5Cl

DOS

IR

Vibrations