Geometry & MOs

Info

ID:	387616
PubChem CID:	134986173
Reduced:	OS2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	223.120843
ΔH_f, kcal/mol:	-5.08
Dipole, Da:	4.29
IP(EA), eV:	-8.4(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,4-dimethoxyphenyl)but-3-enyl]hydroxylamine

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1/C=C(\SC)/S(=O)C

DOS

IR

Vibrations