Geometry & MOs

Info

ID:	159219
PubChem CID:	57264436
Reduced:	NOC9H17 (1)
Stoich.:	ABC9D17 (1)
Weight, g/mol:	192.126263
ΔH_f, kcal/mol:	-45.49
Dipole, Da:	1.22
IP(EA), eV:	-9.01(2.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-diamino-1-phenylpentan-1-one

Drug info:

PubChemData

Smile

C1CC[C@@H]([C@H](C1)NC2CC2)O

DOS

IR

Vibrations