Geometry & MOs

Info

ID:	51479
PubChem CID:	12014156
Reduced:	N3C17H21 (1)
Stoich.:	A3B17C21 (1)
Weight, g/mol:	356.209993
ΔH_f, kcal/mol:	54.6
Dipole, Da:	2.57
IP(EA), eV:	-9.18(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-3-(dibenzylamino)-5-methyl-1-nitrohexan-2-ol

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)NC(=N[C@@H](C)C2=CC=CC=C2)N

DOS

IR

Vibrations