Geometry & MOs

Info

ID:	2807
PubChem CID:	8602
Reduced:	ClNO2C10H10 (1)
Stoich.:	ABC2D10E10 (1)
Weight, g/mol:	211.040006
ΔH_f, kcal/mol:	-73.26
Dipole, Da:	3.04
IP(EA), eV:	-9.5(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloroethyl)-2,3-dihydro-1,3-benzoxazin-4-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)NC(O2)CCCl

DOS

IR

Vibrations