Geometry & MOs

Info

ID:	211489
PubChem CID:	81044082
Reduced:	ON3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	309.139865
ΔH_f, kcal/mol:	-37.6
Dipole, Da:	6.0
IP(EA), eV:	-9.05(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-hydroxybut-1-ynyl)-N,4-dimethyl-N-(2-propan-2-yloxyethyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=CC=NC=C1)C2CCCNC2

DOS

IR

Vibrations