Geometry & MOs

Info

ID:	54480
PubChem CID:	17388748
Reduced:	BrN2O3C19H27 (1)
Stoich.:	AB2C3D19E27 (1)
Weight, g/mol:	307.189592
ΔH_f, kcal/mol:	-126.68
Dipole, Da:	5.89
IP(EA), eV:	-8.9(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(furan-2-yl)prop-2-enoic acid;(2,2,6,6-tetramethylpiperidin-4-ylidene)hydrazine

Drug info:

PubChemData

Smile

CCOC(=O)C[N+]12CCC(CC1)CC2C(=O)N(C)C3=CC=CC=C3.[Br-]

DOS

IR

Vibrations