Geometry & MOs

Info

ID:	399569
PubChem CID:	135040961
Reduced:	NOC12H17 (1)
Stoich.:	ABC12D17 (1)
Weight, g/mol:	215.117095
ΔH_f, kcal/mol:	25.64
Dipole, Da:	5.32
IP(EA), eV:	-8.98(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyclopropyl-1-methyltriazol-4-yl)pyridin-2-amine

Drug info:

PubChemData

Smile

C/C=C/C[N@+](C)(C1=CC=C(C=C1)C)[O-]

DOS

IR

Vibrations