Geometry & MOs

Info

ID:	169954
PubChem CID:	75174028
Reduced:	FN4O5C26H29 (1)
Stoich.:	AB4C5D26E29 (1)
Weight, g/mol:	466.140783
ΔH_f, kcal/mol:	-207.92
Dipole, Da:	8.26
IP(EA), eV:	-8.95(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-4-methylphenyl)-N-(furan-2-ylmethyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-1,2,4-triazinane-6-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCN(C1)C(=O)C2C(=O)N(C(=O)N(N2)C3=CC(=CC=C3)F)CC4=CC=CC(=C4)C

DOS

IR

Vibrations