Geometry & MOs

Info

ID:	61429
PubChem CID:	26709288
Reduced:	O2N5H25C28 (1)
Stoich.:	A2B5C25D28 (1)
Weight, g/mol:	371.144533
ΔH_f, kcal/mol:	59.71
Dipole, Da:	3.33
IP(EA), eV:	-9.32(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethoxy)-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]benzamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

DOS

IR

Vibrations