Geometry & MOs

Info

ID:	203504
PubChem CID:	79839314
Reduced:	ClON2C13H19 (1)
Stoich.:	ABC2D13E19 (1)
Weight, g/mol:	217.157898
ΔH_f, kcal/mol:	-40.86
Dipole, Da:	4.04
IP(EA), eV:	-8.91(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3,3-dimethylbutan-2-yl(methyl)amino]pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

C1CCC(CC1)OCCNC2=C(C=NC=C2)Cl

DOS

IR

Vibrations