Geometry & MOs

Info

ID:	306373
PubChem CID:	125011488
Reduced:	NOC6H8 (4)
Stoich.:	ABC6D8 (4)
Weight, g/mol:	331.225977
ΔH_f, kcal/mol:	-163.75
Dipole, Da:	8.76
IP(EA), eV:	-8.9(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4R)-4-hydroxy-3,3-dimethyl-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[5.5]undecan-2-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C2C=NC=CC2=N1)N3CCC[C@](C3)(CNC(=O)CC4(CCCC4)CC(=O)O)O

DOS

IR

Vibrations