Geometry & MOs

Info

ID:	142310
PubChem CID:	53015312
Reduced:	ON3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	235.103085
ΔH_f, kcal/mol:	-35.19
Dipole, Da:	2.28
IP(EA), eV:	-8.41(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-prop-2-enyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC2(CC1)C(=O)NC3=CC=CC=C3N2

DOS

IR

Vibrations