Geometry & MOs

Info

ID:	175791
PubChem CID:	75948361
Reduced:	FO2N4C26H27 (1)
Stoich.:	AB2C4D26E27 (1)
Weight, g/mol:	356.159689
ΔH_f, kcal/mol:	-70.61
Dipole, Da:	3.1
IP(EA), eV:	-8.48(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-N,5-dimethyl-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC=CC=C2NC3=CC=CC=C3)CNC(=O)NC4=CC(=CC=C4)F

DOS

IR

Vibrations