Geometry & MOs

Info

ID:	405754
PubChem CID:	135075305
Reduced:	NSO2C21H35 (1)
Stoich.:	ABC2D21E35 (1)
Weight, g/mol:	375.114044
ΔH_f, kcal/mol:	-108.82
Dipole, Da:	5.93
IP(EA), eV:	-9.44(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-4-phenylmethoxybut-2-enyl] N-(4-methylphenyl)sulfonylcarbamate

Drug info:

PubChemData

Smile

C/C=C/CCCNS(=O)(=O)C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C

DOS

IR

Vibrations