Geometry & MOs

Info

ID:	147079
PubChem CID:	53786717
Reduced:	N3O7C35H49 (1)
Stoich.:	A3B7C35D49 (1)
Weight, g/mol:	257.068808
ΔH_f, kcal/mol:	-319.52
Dipole, Da:	7.86
IP(EA), eV:	-8.85(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-(furan-2-yl)-2-phenyl-4,5-dihydro-1,3-oxazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OC1=CC(=CC(=C1)C(CNC(C)(C)CNC(=O)[C@@H]2CCCN2C(=O)CC3=CC=CC=C3)O)OC(=O)C(C)(C)C

DOS

IR

Vibrations