Geometry & MOs

Info

ID:	200112
PubChem CID:	79349393
Reduced:	ClN2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	287.082744
ΔH_f, kcal/mol:	-115.96
Dipole, Da:	2.97
IP(EA), eV:	-8.68(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxyethyl N-[1-(4-methylsulfonylphenyl)ethyl]carbamate

Drug info:

PubChemData

Smile

CCNC1C2=CC(=C(C=C2NC1=O)OC(C)COC)Cl

DOS

IR

Vibrations