Geometry & MOs

Info

ID:	147711
PubChem CID:	53787368
Reduced:	NO2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	236.09277
ΔH_f, kcal/mol:	-36.46
Dipole, Da:	6.91
IP(EA), eV:	-8.62(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl N-[1-chloro-2-(ethylamino)-2-oxoethyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C=C2CC(=O)O)CC3=CC=CC=C3

DOS

IR

Vibrations