Geometry & MOs

Info

ID:	122501
PubChem CID:	50809501
Reduced:	SN2O5C18H24 (1)
Stoich.:	AB2C5D18E24 (1)
Weight, g/mol:	345.168856
ΔH_f, kcal/mol:	-129.19
Dipole, Da:	8.11
IP(EA), eV:	-9.07(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-methoxy-4-[[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methyl]phenoxy]acetamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=C1)C2CCCN2S(=O)(=O)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations