Geometry & MOs

Info

ID:	265130
PubChem CID:	103510952
Reduced:	ON4C10H14 (1)
Stoich.:	AB4C10D14 (1)
Weight, g/mol:	264.104482
ΔH_f, kcal/mol:	11.2
Dipole, Da:	1.81
IP(EA), eV:	-9.77(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylimidazole-4-carbonyl)-4-methylsulfanylpiperidine-4-carbonitrile

Drug info:

PubChemData

Smile

CC(C)N(CC#N)C(=O)C1=CN=CN1C

DOS

IR

Vibrations