Geometry & MOs

Info

ID:	142538
PubChem CID:	53052834
Reduced:	N2O3C21H24 (1)
Stoich.:	A2B3C21D24 (1)
Weight, g/mol:	348.158626
ΔH_f, kcal/mol:	-98.9
Dipole, Da:	10.88
IP(EA), eV:	-8.95(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-N-[2-(furan-2-yl)ethyl]-3-(4-methylphenyl)-[1,2]oxazolo[4,5-d]pyrimidin-7-amine

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations