Geometry & MOs

Info

ID:	235397
PubChem CID:	92708348
Reduced:	SO2N3C18H19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	373.109627
ΔH_f, kcal/mol:	-9.66
Dipole, Da:	2.51
IP(EA), eV:	-8.86(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(3,5-dimethoxyphenyl)-2-([1,3]oxazolo[4,5-b]pyridin-2-ylsulfanyl)butanamide

Drug info:

PubChemData

Smile

CC[C@H](C(=O)NC1=CC=CC(=C1C)C)SC2=NC3=C(O2)C=CC=N3

DOS

IR

Vibrations