Geometry & MOs

Info

ID:	213295
PubChem CID:	81063367
Reduced:	ON2C18H36 (1)
Stoich.:	AB2C18D36 (1)
Weight, g/mol:	353.025535
ΔH_f, kcal/mol:	-58.28
Dipole, Da:	1.04
IP(EA), eV:	-8.7(2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-5-[2-ethoxyethyl(methyl)carbamoyl]-2-methylbenzenesulfonyl chloride

Drug info:

PubChemData

Smile

CC(C)OCCN(C)CC1(CCCCCC1)CNC2CC2

DOS

IR

Vibrations