Geometry & MOs

Info

ID:	417010
PubChem CID:	135091087
Reduced:	O2N5C20H25 (1)
Stoich.:	A2B5C20D25 (1)
Weight, g/mol:	365.235479
ΔH_f, kcal/mol:	-11.53
Dipole, Da:	1.8
IP(EA), eV:	-9.01(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-9-[[4-(3-methylphenyl)phenyl]methyl]-1-oxa-9-azaspiro[5.5]undecan-4-ol

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=CN=C(N=C3)C4=CC=CC=N4)CO

DOS

IR

Vibrations