Geometry & MOs

Info

ID:	405246
PubChem CID:	135073185
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	322.240899
ΔH_f, kcal/mol:	-121.52
Dipole, Da:	1.84
IP(EA), eV:	-10.0(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-N-benzyl-4-methyl-2-N-phenyl-1-N-prop-2-enylpentane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)(C)C[C@@H](C(=O)OC)NC(=O)C1=CC=CC=N1

DOS

IR

Vibrations