Geometry & MOs

Info

ID:	206451
PubChem CID:	80251933
Reduced:	NOSC15H19 (1)
Stoich.:	ABCD15E19 (1)
Weight, g/mol:	290.145285
ΔH_f, kcal/mol:	-18.08
Dipole, Da:	3.11
IP(EA), eV:	-9.18(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-carbamothioylphenyl)methyl]-1-ethylcyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC1=CC=C(C=C1)C(CC2=NC=CS2)O

DOS

IR

Vibrations