Geometry & MOs

Info

ID:	179389
PubChem CID:	76475871
Reduced:	SO6N7C20H29 (1)
Stoich.:	AB6C7D20E29 (1)
Weight, g/mol:	456.262422
ΔH_f, kcal/mol:	-192.95
Dipole, Da:	10.03
IP(EA), eV:	-9.38(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-benzyl-5-(1-hydroxy-4-pyridin-2-yloxybutyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Drug info:

PubChemData

Smile

CNC(C=O)C(CC(NS(=O)(=O)CC1=CC=CC=C1)N=C(N)N)C(=O)CN2CCC(=O)NC2=O

DOS

IR

Vibrations