Geometry & MOs

Info

ID:	406491
PubChem CID:	135077811
Reduced:	NSO2C16H21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	391.81563
ΔH_f, kcal/mol:	-10.13
Dipole, Da:	6.22
IP(EA), eV:	-9.66(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C/C=C/C(C)C)CC#C

DOS

IR

Vibrations