Geometry & MOs

Info

ID:	206537
PubChem CID:	80266872
Reduced:	O2N3C12H19 (1)
Stoich.:	A2B3C12D19 (1)
Weight, g/mol:	305.083413
ΔH_f, kcal/mol:	-59.49
Dipole, Da:	3.36
IP(EA), eV:	-9.56(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[ethyl(pyridin-2-ylmethyl)carbamoyl]amino]thiophene-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=N1)C(=O)COCCN

DOS

IR

Vibrations