Geometry & MOs

Info

ID:	369477
PubChem CID:	127334145
Reduced:	SN4O4C16H24 (1)
Stoich.:	AB4C4D16E24 (1)
Weight, g/mol:	344.176979
ΔH_f, kcal/mol:	-145.44
Dipole, Da:	7.5
IP(EA), eV:	-9.8(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-N-[1-(oxan-4-ylsulfonyl)piperidin-4-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(=O)NC2CCN(CC2)S(=O)(=O)C3CCOCC3

DOS

IR

Vibrations