Geometry & MOs

Info

ID:	224722
PubChem CID:	85348983
Reduced:	NOSC12H15 (1)
Stoich.:	ABCD12E15 (1)
Weight, g/mol:	221.081871
ΔH_f, kcal/mol:	-9.73
Dipole, Da:	2.13
IP(EA), eV:	-8.82(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-5-methoxypent-3-en-2-yl) N,N-dimethylcarbamate

Drug info:

PubChemData

Smile

CSC=CC(=O)NCCC1=CC=CC=C1

DOS

IR

Vibrations