Geometry & MOs

Info

ID:	74132
PubChem CID:	48421501
Reduced:	ClN2O3C16H21 (1)
Stoich.:	AB2C3D16E21 (1)
Weight, g/mol:	290.163043
ΔH_f, kcal/mol:	-120.85
Dipole, Da:	5.91
IP(EA), eV:	-8.81(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropyl-[(3-methylphenyl)carbamoyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(C1CC1)C(=O)NC2=CC(=C(C=C2)C)Cl

DOS

IR

Vibrations