Geometry & MOs

Info

ID:	69523
PubChem CID:	47193699
Reduced:	ClNOC6H7 (2)
Stoich.:	ABCD6E7 (2)
Weight, g/mol:	318.053798
ΔH_f, kcal/mol:	-88.76
Dipole, Da:	3.47
IP(EA), eV:	-9.39(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 3-[(3,5-dichlorophenyl)carbamoylamino]propanoate

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)NC2=CC(=CC(=C2)Cl)Cl

DOS

IR

Vibrations