Geometry & MOs

Info

ID:	406371
PubChem CID:	135077388
Reduced:	NSO4C18H19 (1)
Stoich.:	ABC4D18E19 (1)
Weight, g/mol:	311.119129
ΔH_f, kcal/mol:	-121.28
Dipole, Da:	5.93
IP(EA), eV:	-9.31(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-5-methylhex-2-enyl] N-(4-methylphenyl)sulfonylcarbamate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OC/C=C/CC2=CC=CC=C2

DOS

IR

Vibrations