Geometry & MOs

Info

ID:	414250
PubChem CID:	135087206
Reduced:	N2O3C18H26 (1)
Stoich.:	A2B3C18D26 (1)
Weight, g/mol:	298.135114
ΔH_f, kcal/mol:	-115.57
Dipole, Da:	4.43
IP(EA), eV:	-8.91(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)CC3=CC(=CC=C3)C(=O)O)CO

DOS

IR

Vibrations