Geometry & MOs

Info

ID:	255170
PubChem CID:	103130510
Reduced:	ON4C10H10 (1)
Stoich.:	AB4C10D10 (1)
Weight, g/mol:	201.090212
ΔH_f, kcal/mol:	53.81
Dipole, Da:	6.42
IP(EA), eV:	-9.94(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylpyrazol-3-yl)-(3-methylpyridin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1)C(=O)C2=NN(C=C2)C

DOS

IR

Vibrations