Geometry & MOs

Info

ID:	129994
PubChem CID:	51074511
Reduced:	SN5C13H15 (1)
Stoich.:	AB5C13D15 (1)
Weight, g/mol:	349.153875
ΔH_f, kcal/mol:	106.99
Dipole, Da:	7.15
IP(EA), eV:	-8.93(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=NC2=NC=NN2C(=C1)N(C)C(C)C3=CC=CS3

DOS

IR

Vibrations