Geometry & MOs

Info

ID:	27314
PubChem CID:	820520
Reduced:	NO4H11C12 (1)
Stoich.:	AB4C11D12 (1)
Weight, g/mol:	201.078979
ΔH_f, kcal/mol:	-40.98
Dipole, Da:	4.49
IP(EA), eV:	-10.7(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-(1H-indol-3-yl)-2-methylprop-2-enoic acid

Drug info:

PubChemData

Smile

C=CCC(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)O

DOS

IR

Vibrations