Geometry & MOs

Info

ID:	415624
PubChem CID:	135088623
Reduced:	SN3O3C18H19 (1)
Stoich.:	AB3C3D18E19 (1)
Weight, g/mol:	353.138699
ΔH_f, kcal/mol:	-40.31
Dipole, Da:	2.95
IP(EA), eV:	-8.42(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-dihydroxypropan-2-yl)-3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1OCCCN(C2)CC3=CC(=O)N4C=CSC4=N3

DOS

IR

Vibrations