Geometry & MOs

Info

ID:	329460
PubChem CID:	126737063
Reduced:	O3N4C25H30 (1)
Stoich.:	A3B4C25D30 (1)
Weight, g/mol:	294.095082
ΔH_f, kcal/mol:	-18.83
Dipole, Da:	3.99
IP(EA), eV:	-8.79(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-but-2-enedioic acid;2-methylprop-2-enoic acid;propane-1,2,3-triol

Drug info:

PubChemData

Smile

CN(CCN(C)CC(=O)NN/C=C/1\C(=O)C=CC2=CC=CC=C21)CC3=CC(=CC=C3)OC

DOS

IR

Vibrations