Geometry & MOs

Info

ID:	24569
PubChem CID:	611186
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	275.126991
ΔH_f, kcal/mol:	-34.41
Dipole, Da:	3.32
IP(EA), eV:	-9.16(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-hydroxy-3-methyl-6-phenyl-1,2,4-triazin-3-yl)acetate

Drug info:

PubChemData

Smile

CCOC(=O)CC1(N=NC(=CN1O)C2=CC=CC=C2)C

DOS

IR

Vibrations