Geometry & MOs

Info

ID:	68660
PubChem CID:	46508854
Reduced:	N2O2C12H17 (2)
Stoich.:	A2B2C12D17 (2)
Weight, g/mol:	387.215806
ΔH_f, kcal/mol:	-127.6
Dipole, Da:	4.85
IP(EA), eV:	-8.78(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(ethylcarbamoyl)-2-(6-methylspiro[2,3,6,8-tetrahydro-[1,4]dioxino[2,3-g]isoquinoline-9,1'-cyclopentane]-7-yl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CC1)N2CCN(CC2)CC(=O)N3CCCC3C4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations