Geometry & MOs

Info

ID:	418837
PubChem CID:	135106942
Reduced:	ON2C6H10 (2)
Stoich.:	AB2C6D10 (2)
Weight, g/mol:	390.161329
ΔH_f, kcal/mol:	-68.84
Dipole, Da:	6.87
IP(EA), eV:	-8.98(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-2,3,6-trimethyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1N(C)C)N[C@H](C(C)C)C(=O)O

DOS

IR

Vibrations