Geometry & MOs

Info

ID:	323567
PubChem CID:	126675485
Reduced:	N6C15H16 (1)
Stoich.:	A6B15C16 (1)
Weight, g/mol:	375.076599
ΔH_f, kcal/mol:	93.05
Dipole, Da:	3.46
IP(EA), eV:	-8.18(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[1-[(2,4-dichlorophenyl)methyl]pyrazol-4-yl]methyl]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C=CC(=N2)CC3=CC(=NC(=C3N)N)N

DOS

IR

Vibrations