Geometry & MOs

Info

ID:	281207
PubChem CID:	103911456
Reduced:	N2O3C16H32 (1)
Stoich.:	A2B3C16D32 (1)
Weight, g/mol:	273.095413
ΔH_f, kcal/mol:	-188.32
Dipole, Da:	3.16
IP(EA), eV:	-8.86(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-N-(2-methylsulfinylpropyl)propan-2-amine

Drug info:

PubChemData

Smile

CCCN(CCNC1CCOC(C1)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations