Geometry & MOs

Info

ID:	135534
PubChem CID:	51888429
Reduced:	N2C13H28 (1)
Stoich.:	A2B13C28 (1)
Weight, g/mol:	199.990804
ΔH_f, kcal/mol:	-20.5
Dipole, Da:	2.34
IP(EA), eV:	-8.75(1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-2-(3,5-dichlorophenyl)acetonitrile

Drug info:

PubChemData

Smile

C1CCC[NH+](CC1)CC[NH2+]C2CCCC2

DOS

IR

Vibrations