Geometry & MOs

Info

ID:	48894
PubChem CID:	11528446
Reduced:	OC12H18 (1)
Stoich.:	AB12C18 (1)
Weight, g/mol:	178.146999
ΔH_f, kcal/mol:	-55.43
Dipole, Da:	2.39
IP(EA), eV:	-9.01(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-phenylpentane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(C)CCO

DOS

IR

Vibrations