Geometry & MOs

Info

ID:	387901
PubChem CID:	134987328
Reduced:	ISC9H15 (1)
Stoich.:	ABC9D15 (1)
Weight, g/mol:	275.098
ΔH_f, kcal/mol:	4.42
Dipole, Da:	3.16
IP(EA), eV:	-8.46(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-but-3-enyl-N-but-3-en-1-ynyl-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CS/C(=C/C1CCCCC1)/I

DOS

IR

Vibrations