Geometry & MOs

Info

ID:	61611
PubChem CID:	26710948
Reduced:	SF2N2O5C23H26 (1)
Stoich.:	AB2C2D5E23F26 (1)
Weight, g/mol:	494.1687
ΔH_f, kcal/mol:	-236.39
Dipole, Da:	5.25
IP(EA), eV:	-9.15(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-piperidin-1-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CN(C2CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)OC(F)F

DOS

IR

Vibrations