Geometry & MOs

Info

ID:	251341
PubChem CID:	103103301
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	299.093977
ΔH_f, kcal/mol:	-77.42
Dipole, Da:	4.35
IP(EA), eV:	-8.6(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2-amino-2-oxoethyl)-ethylcarbamoyl]amino]-4,5-dimethylthiophene-3-carboxylic acid

Drug info:

PubChemData

Smile

CCNC1=CC=CC=C1C(=O)N(CC)CC(=O)N

DOS

IR

Vibrations