Geometry & MOs

Info

ID:	144523
PubChem CID:	53381208
Reduced:	IO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	602.2967
ΔH_f, kcal/mol:	-56.09
Dipole, Da:	6.97
IP(EA), eV:	-9.15(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2R)-2-[bis(3-phenylpropyl)amino]-1,2-diphenylethyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)CI)OCC2=CC=CC=C2

DOS

IR

Vibrations