Geometry & MOs

Info

ID:	422675
PubChem CID:	135118229
Reduced:	F2N2O3C19H22 (1)
Stoich.:	A2B2C3D19E22 (1)
Weight, g/mol:	379.205991
ΔH_f, kcal/mol:	-199.95
Dipole, Da:	5.58
IP(EA), eV:	-9.49(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-2-[(3-fluoro-4-methylphenyl)methyl]benzamide

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)C2=CC=C(C=C2)OC(F)F)C(=O)C3CC=CC3

DOS

IR

Vibrations