Geometry & MOs

Info

ID:	421047
PubChem CID:	135115284
Reduced:	O2N3C17H25 (1)
Stoich.:	A2B3C17D25 (1)
Weight, g/mol:	287.126991
ΔH_f, kcal/mol:	-45.92
Dipole, Da:	4.27
IP(EA), eV:	-9.08(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)CN(CCO)CC2=CN=CN2C)OC)C

DOS

IR

Vibrations