Geometry & MOs

Info

ID:	45970
PubChem CID:	10519899
Reduced:	SO2C19H30 (1)
Stoich.:	AB2C19D30 (1)
Weight, g/mol:	322.89795
ΔH_f, kcal/mol:	-89.04
Dipole, Da:	4.94
IP(EA), eV:	-7.97(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NZ)-N-[2,2-dibromo-1-(4-methoxyphenyl)ethylidene]hydroxylamine

Drug info:

PubChemData

Smile

CCCC[C@H](C(C)C)/C(=C/[C@@H](C)O)/[S@@](=O)C1=CC=C(C=C1)C

DOS

IR

Vibrations