Geometry & MOs

Info

ID:	338429
PubChem CID:	127259121
Reduced:	ClNO3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	227.034921
ΔH_f, kcal/mol:	-122.51
Dipole, Da:	6.69
IP(EA), eV:	-8.55(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4-chlorophenyl)-methylcarbamoyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC1(CCCCC1=O)NC2=CC=C(C=C2)Cl

DOS

IR

Vibrations