Geometry & MOs

Info

ID:	324487
PubChem CID:	126677750
Reduced:	PN5O5C41H54 (1)
Stoich.:	AB5C5D41E54 (1)
Weight, g/mol:	206.153147
ΔH_f, kcal/mol:	-192.24
Dipole, Da:	6.39
IP(EA), eV:	-8.6(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-7-(1H-pyrazol-5-yl)-2,7-diazaspiro[3.5]nonane

Drug info:

PubChemData

Smile

C/C(=C/N(C=O)C1CN(CC(O1)COP(=O)(C)N2CCC(CC2)N3CCCCC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)/C(=O)NC

DOS

IR

Vibrations