Geometry & MOs

Info

ID:	289072
PubChem CID:	104333983
Reduced:	SN2O2F3C13H17 (1)
Stoich.:	AB2C2D3E13F17 (1)
Weight, g/mol:	314.177647
ΔH_f, kcal/mol:	-198.67
Dipole, Da:	5.53
IP(EA), eV:	-9.08(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(4-methylpiperidin-4-yl)methyl]-1-propylimidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1(CCNCC1)CNS(=O)(=O)C2=C(C(=C(C=C2)F)F)F

DOS

IR

Vibrations