Geometry & MOs

Info

ID:	417817
PubChem CID:	135102817
Reduced:	FO3N4C20H27 (1)
Stoich.:	AB3C4D20E27 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-93.3
Dipole, Da:	4.77
IP(EA), eV:	-8.9(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-5-methyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(CN1CCCC1)NC(=O)C2=C(ON=C2N(C)C)C3=CC(=C(C=C3)F)OC

DOS

IR

Vibrations