Geometry & MOs

Info

ID:	418666
PubChem CID:	135106517
Reduced:	O2N5C22H25 (1)
Stoich.:	A2B5C22D25 (1)
Weight, g/mol:	266.199428
ΔH_f, kcal/mol:	-18.02
Dipole, Da:	4.27
IP(EA), eV:	-9.27(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4R,5R)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-1-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

CC(C)NC1=NC=C(C=N1)C(=O)N2C[C@H]([C@H](C2)O)CC3=CC=NC4=CC=CC=C34

DOS

IR

Vibrations