Geometry & MOs

Info

ID:	309260
PubChem CID:	126541286
Reduced:	SN2O4C24H30 (1)
Stoich.:	AB2C4D24E30 (1)
Weight, g/mol:	193.092521
ΔH_f, kcal/mol:	-118.16
Dipole, Da:	7.13
IP(EA), eV:	-8.76(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylidenebutylsulfanyl)aniline

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)CN(C2=CC=CC=C2)S(=O)(=O)C3CCN(CC3)C4CCC4

DOS

IR

Vibrations