Geometry & MOs

Info

ID:	367183
PubChem CID:	127323949
Reduced:	ON5C19H31 (1)
Stoich.:	AB5C19D31 (1)
Weight, g/mol:	374.268176
ΔH_f, kcal/mol:	-54.29
Dipole, Da:	2.81
IP(EA), eV:	-9.55(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)NC3CCC4CCCCC4C3

DOS

IR

Vibrations