Geometry & MOs

Info

ID:	247705
PubChem CID:	103072763
Reduced:	N4C9H12 (1)
Stoich.:	A4B9C12 (1)
Weight, g/mol:	204.137497
ΔH_f, kcal/mol:	83.52
Dipole, Da:	7.4
IP(EA), eV:	-9.55(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(propan-2-ylamino)methyl]prop-2-enyl]imidazole-2-carbonitrile

Drug info:

PubChemData

Smile

CNCC(=C)CN1C=CN=C1C#N

DOS

IR

Vibrations