Geometry & MOs

Info

ID:	357307
PubChem CID:	127293940
Reduced:	ON2C11H17 (2)
Stoich.:	AB2C11D17 (2)
Weight, g/mol:	349.179027
ΔH_f, kcal/mol:	-99.84
Dipole, Da:	5.85
IP(EA), eV:	-8.09(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-2-phenyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(N1C(C)C(=O)NC2=CC=C(C=C2)NC(=O)N3CCCCCC3)C

DOS

IR

Vibrations