Geometry & MOs

Info

ID:	161459
PubChem CID:	57391724
Reduced:	N2H18C25 (1)
Stoich.:	A2B18C25 (1)
Weight, g/mol:	335.246044
ΔH_f, kcal/mol:	122.09
Dipole, Da:	3.71
IP(EA), eV:	-8.73(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-dodecanoyl-1,3,5-trimethylpyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

DOS

IR

Vibrations