Geometry & MOs

Info

ID:	346584
PubChem CID:	127271088
Reduced:	SN3O5C18H25 (1)
Stoich.:	AB3C5D18E25 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-194.13
Dipole, Da:	3.4
IP(EA), eV:	-9.84(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[1-(oxolan-2-yl)propan-2-yl]-6-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

DOS

IR

Vibrations