Geometry & MOs

Info

ID:	148758
PubChem CID:	53788427
Reduced:	ClNO2H18C19 (1)
Stoich.:	ABC2D18E19 (1)
Weight, g/mol:	275.001907
ΔH_f, kcal/mol:	-53.24
Dipole, Da:	4.74
IP(EA), eV:	-9.41(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)sulfonylprop-2-enylcarbamic acid

Drug info:

PubChemData

Smile

C1CC2=NC3=C(C(C2C(=O)C1)C4=CC(=CC=C4)Cl)C(=O)CCC3

DOS

IR

Vibrations