Geometry & MOs

Info

ID:	420012
PubChem CID:	135110757
Reduced:	O2N5C29H41 (1)
Stoich.:	A2B5C29D41 (1)
Weight, g/mol:	393.230394
ΔH_f, kcal/mol:	-64.94
Dipole, Da:	4.99
IP(EA), eV:	-8.83(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-[2-(2-phenylethoxy)phenyl]methanone

Drug info:

PubChemData

Smile

CC(C)CC(=O)N1CCCN(CCCCNC(=O)[C@@H]2C[C@H]1CN2)CC3=CC=C(C=C3)C4=CC=CC=N4

DOS

IR

Vibrations