Geometry & MOs

Info

ID:	345469
PubChem CID:	127269769
Reduced:	ON2C8H16 (2)
Stoich.:	AB2C8D16 (2)
Weight, g/mol:	343.237211
ΔH_f, kcal/mol:	-115.65
Dipole, Da:	2.72
IP(EA), eV:	-8.87(1.48)
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-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)NCCN2CCCCC2)C

DOS

IR

Vibrations