Geometry & MOs

Info

ID:	364219
PubChem CID:	127314523
Reduced:	ON2C10H18 (2)
Stoich.:	AB2C10D18 (2)
Weight, g/mol:	385.236542
ΔH_f, kcal/mol:	-108.98
Dipole, Da:	6.74
IP(EA), eV:	-8.59(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(N1C(C)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3)C

DOS

IR

Vibrations