Geometry & MOs

Info

ID:	420289
PubChem CID:	135112268
Reduced:	SO4N7C28H35 (1)
Stoich.:	AB4C7D28E35 (1)
Weight, g/mol:	290.163043
ΔH_f, kcal/mol:	-71.87
Dipole, Da:	4.79
IP(EA), eV:	-8.8(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2C=C(C=C1)OCCCN3C=C(CN(CCCNC(=O)[C@@H](NC2=O)CCSC)C(=O)C4=CN=CC=C4)N=N3

DOS

IR

Vibrations