Geometry & MOs

Info

ID:	255740
PubChem CID:	103134393
Reduced:	N5C15H17 (1)
Stoich.:	A5B15C17 (1)
Weight, g/mol:	268.143645
ΔH_f, kcal/mol:	116.95
Dipole, Da:	3.38
IP(EA), eV:	-8.82(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1-methylpyrazol-3-yl)-1-(2-phenyltriazol-4-yl)methanamine

Drug info:

PubChemData

Smile

CNC(C1=NN(C=C1)C)C2=CN(N=C2)C3=CC=CC=C3

DOS

IR

Vibrations