Geometry & MOs

Info

ID:	74129
PubChem CID:	48421498
Reduced:	NO2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	344.069448
ΔH_f, kcal/mol:	-143.66
Dipole, Da:	5.27
IP(EA), eV:	-8.7(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropyl-[(3,4-dichlorophenyl)carbamoyl]amino]propanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations