Geometry & MOs

Info

ID:	380380
PubChem CID:	134970813
Reduced:	LiN3C11H16 (1)
Stoich.:	AB3C11D16 (1)
Weight, g/mol:	147.079647
ΔH_f, kcal/mol:	40.47
Dipole, Da:	5.63
IP(EA), eV:	-7.46(1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-2,3-dihydro-1H-triazole

Drug info:

PubChemData

Smile

[Li+].CCN1CCN(CC1)C2=CC=C[C-]=N2

DOS

IR

Vibrations