Geometry & MOs

Info

ID:	423360
PubChem CID:	135119362
Reduced:	O4N7C26H31 (1)
Stoich.:	A4B7C26D31 (1)
Weight, g/mol:	369.172228
ΔH_f, kcal/mol:	-71.95
Dipole, Da:	8.8
IP(EA), eV:	-9.45(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(methoxymethyl)-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]piperidine-1-sulfonamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)NCCCN(CC2=CN(CCCOC3=C(C=CC(=C3)C)C(=O)N1)N=N2)C(=O)C4=CN=CC=C4

DOS

IR

Vibrations