Geometry & MOs

Info

ID:	204531
PubChem CID:	79977778
Reduced:	NO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	300.093249
ΔH_f, kcal/mol:	-63.8
Dipole, Da:	4.09
IP(EA), eV:	-8.93(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-hydroxybut-1-ynyl)-4-methyl-N-(2-methylpyridin-3-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1=CC(=CC=C1)C2CC2)C(C)CC(=O)O

DOS

IR

Vibrations