Geometry & MOs

Info

ID:	49358
PubChem CID:	11532910
Reduced:	ClN4O5C23H23 (1)
Stoich.:	AB4C5D23E23 (1)
Weight, g/mol:	434.151158
ΔH_f, kcal/mol:	-107.13
Dipole, Da:	5.4
IP(EA), eV:	-9.58(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-1-(2-methoxyethyl)-4-(4-phenoxyphenyl)sulfonylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(O1)CN2CC3=CC=CC=C3N(CC2=O)C(=O)C4=C(C=C(C=C4)OCCOC)Cl

DOS

IR

Vibrations