Geometry & MOs

Info

ID:	417375
PubChem CID:	135092942
Reduced:	N3O5C23H27 (1)
Stoich.:	A3B5C23D27 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-164.06
Dipole, Da:	2.89
IP(EA), eV:	-8.57(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C2C=C(C=C1)C3CC(=O)NC4=C3C=CC(=C4)OCCNC(=O)CNCCCO2

DOS

IR

Vibrations