Geometry & MOs

Info

ID:	366848
PubChem CID:	127320536
Reduced:	SN2O2C12H20 (1)
Stoich.:	AB2C2D12E20 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-103.24
Dipole, Da:	1.41
IP(EA), eV:	-9.13(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylazepan-1-yl)-(2-methyl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC1CCCCCN1C(=O)CN2CSCC2=O

DOS

IR

Vibrations