Geometry & MOs

Info

ID:	422106
PubChem CID:	135117215
Reduced:	NOC5H7 (4)
Stoich.:	ABC5D7 (4)
Weight, g/mol:	323.144533
ΔH_f, kcal/mol:	-90.5
Dipole, Da:	3.35
IP(EA), eV:	-8.5(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2,3-difluoro-6-methoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CCC(CNC1=NOC(=C1C(=O)O)C2=CC=C(C=C2)OC)N3CCN(CC3)C

DOS

IR

Vibrations