Geometry & MOs

Info

ID:	255752
PubChem CID:	103134537
Reduced:	N5C11H15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	286.120509
ΔH_f, kcal/mol:	77.85
Dipole, Da:	7.38
IP(EA), eV:	-9.48(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methyloxolan-2-yl)methoxy]naphthalene-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(N=N1)C)C(C2=NN(C=C2)C)N

DOS

IR

Vibrations