Geometry & MOs

Info

ID:	76087
PubChem CID:	48424409
Reduced:	NCl2O3C19H23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-105.64
Dipole, Da:	2.7
IP(EA), eV:	-9.43(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetamido-2,4-dimethylphenyl)-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC(CC1)C(=O)C2=CC(=C(C=C2)Cl)Cl)OCC3CC3

DOS

IR

Vibrations