Geometry & MOs

Info

ID:	368365
PubChem CID:	127328087
Reduced:	ON3C14H27 (1)
Stoich.:	AB3C14D27 (1)
Weight, g/mol:	365.224932
ΔH_f, kcal/mol:	-87.93
Dipole, Da:	1.9
IP(EA), eV:	-8.77(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpiperidin-4-yl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCCC1)NC(=O)NC2CCN(CC2)C

DOS

IR

Vibrations