Geometry & MOs

Info

ID:	364592
PubChem CID:	127315844
Reduced:	NC7H14 (2)
Stoich.:	AB7C14 (2)
Weight, g/mol:	239.145619
ΔH_f, kcal/mol:	-27.15
Dipole, Da:	2.47
IP(EA), eV:	-8.36(2.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4,7-dimethyl-1,4-diazepan-1-yl)methyl]-2-methyl-1,3-thiazole

Drug info:

PubChemData

Smile

CC1CCN(CCN1CC2CCCCC2)C

DOS

IR

Vibrations