Geometry & MOs

Info

ID:	418486
PubChem CID:	135105157
Reduced:	N2O3C14H15 (2)
Stoich.:	A2B3C14D15 (2)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	-107.92
Dipole, Da:	5.97
IP(EA), eV:	-8.48(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C3C4=CC=C(C=C4)OCCOCCN(CC(=O)N3CCC2=C1)C(=O)C5=NC=CN=C5)OC

DOS

IR

Vibrations