Geometry & MOs

Info

ID:	294406
PubChem CID:	117459484
Reduced:	SO2N3H11C14 (1)
Stoich.:	AB2C3D11E14 (1)
Weight, g/mol:	285.154035
ΔH_f, kcal/mol:	22.55
Dipole, Da:	4.46
IP(EA), eV:	-9.08(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-(difluoromethyl)-2,5-dimethoxyphenyl]methyl]piperidine

Drug info:

PubChemData

Smile

C1CC1C2=NC3=C(C=CC=C3S2)C4=NNC(=C4)C(=O)O

DOS

IR

Vibrations