Geometry & MOs

Info

ID:	80026
PubChem CID:	49832280
Reduced:	N3O4H13C15 (1)
Stoich.:	A3B4C13D15 (1)
Weight, g/mol:	382.088889
ΔH_f, kcal/mol:	-97.44
Dipole, Da:	7.93
IP(EA), eV:	-9.44(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[6-methyl-2,7-dioxo-5-(trifluoromethyl)-1,4-dihydropyrazolo[1,5-a]pyrimidin-3-yl]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2NC(=CC(=O)N2NC1=O)C3=CC=CC=C3

DOS

IR

Vibrations