Geometry & MOs

Info

ID:	146853
PubChem CID:	53760404
Reduced:	Cl5C8H13 (1)
Stoich.:	A5B8C13 (1)
Weight, g/mol:	280.132411
ΔH_f, kcal/mol:	-70.13
Dipole, Da:	2.38
IP(EA), eV:	-11.09(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxyphenyl)-3-methyl-4-(1H-pyrazol-4-yl)pyridin-2-amine

Drug info:

PubChemData

Smile

CCCCCCC(C(Cl)(Cl)Cl)(Cl)Cl

DOS

IR

Vibrations