Geometry & MOs

Info

ID:	370427
PubChem CID:	127338647
Reduced:	N3O3C16H25 (1)
Stoich.:	A3B3C16D25 (1)
Weight, g/mol:	354.194343
ΔH_f, kcal/mol:	-92.12
Dipole, Da:	5.56
IP(EA), eV:	-9.05(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-hydroxynaphthalen-2-yl)-[2-(morpholin-4-ylmethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(=O)N2CCCCC2CN3CCOCC3

DOS

IR

Vibrations