Geometry & MOs

Info

ID:	206664
PubChem CID:	80278927
Reduced:	N2C4H5 (2)
Stoich.:	A2B4C5 (2)
Weight, g/mol:	212.106196
ΔH_f, kcal/mol:	85.68
Dipole, Da:	7.34
IP(EA), eV:	-9.77(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(1R)-1-aminoethyl]phenyl]imidazole-2-carbonitrile

Drug info:

PubChemData

Smile

C1=CN(C(=N1)C#N)CC=CCN

DOS

IR

Vibrations