Geometry & MOs

Info

ID:	55919
PubChem CID:	17397435
Reduced:	ClN2O5H15C17 (1)
Stoich.:	AB2C5D15E17 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-118.45
Dipole, Da:	8.23
IP(EA), eV:	-8.77(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(cyclopropylcarbamoyl)phenyl]-2,5-diethoxybenzamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(=O)NC2=NC3=C(O2)C=CC(=C3)Cl)OC)OC

DOS

IR

Vibrations