Geometry & MOs

Info

ID:	312608
PubChem CID:	126606791
Reduced:	N2O4H12C13 (1)
Stoich.:	A2B4C12D13 (1)
Weight, g/mol:	264.099774
ΔH_f, kcal/mol:	-133.57
Dipole, Da:	3.31
IP(EA), eV:	-9.09(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5,6,7-trimethoxynaphthalen-2-yl)methanediol

Drug info:

PubChemData

Smile

C1=CC(=C(C2=C1C(=C(C=C2)C(=O)O)CN)N)C(=O)O

DOS

IR

Vibrations