Geometry & MOs

Info

ID:	328957
PubChem CID:	126729555
Reduced:	ON6C10H18 (1)
Stoich.:	AB6C10D18 (1)
Weight, g/mol:	440.14601
ΔH_f, kcal/mol:	75.7
Dipole, Da:	3.67
IP(EA), eV:	-9.91(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(4-methoxyphenyl)-2-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridin-4-amine

Drug info:

PubChemData

Smile

COCC1CC(CC(C1)CN=[N+]=[N-])CN=[N+]=[N-]

DOS

IR

Vibrations