Geometry & MOs

Info

ID:	437331
PubChem CID:	135224789
Reduced:	INOC8H10 (1)
Stoich.:	ABCD8E10 (1)
Weight, g/mol:	556.341341
ΔH_f, kcal/mol:	-7.68
Dipole, Da:	2.34
IP(EA), eV:	-9.1(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7-[4-(4-naphthalen-1-ylpiperazin-1-yl)butoxy]-3,4-dihydro-2H-1,8-naphthyridin-1-yl]methyl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)OCCI

DOS

IR

Vibrations