Geometry & MOs

Info

ID:	199966
PubChem CID:	79324869
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	281.173942
ΔH_f, kcal/mol:	-128.08
Dipole, Da:	7.39
IP(EA), eV:	-9.6(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[3-(diethylamino)propylcarbamoyl]pyrrol-1-yl]acetic acid

Drug info:

PubChemData

Smile

C1CCC(C1)CCNC(=O)C2=CC=CN2CC(=O)O

DOS

IR

Vibrations