Geometry & MOs

Info

ID:	392688
PubChem CID:	135017621
Reduced:	NO2C7H11 (1)
Stoich.:	AB2C7D11 (1)
Weight, g/mol:	336.183778
ΔH_f, kcal/mol:	-74.41
Dipole, Da:	2.39
IP(EA), eV:	-9.44(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dibenzylamino)-4-(1,3-dioxolan-2-yl)butanenitrile

Drug info:

PubChemData

Smile

CC(=O)N1CCOC(=C)C1

DOS

IR

Vibrations