Geometry & MOs

Info

ID:	212721
PubChem CID:	81061618
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	266.108899
ΔH_f, kcal/mol:	-109.21
Dipole, Da:	8.67
IP(EA), eV:	-9.18(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-aminoprop-1-ynyl)-N-(2-ethoxyethyl)-N-methylthiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)OCCN(C)CC1=CC(=CC=C1)/C=C/C(=O)O

DOS

IR

Vibrations