Geometry & MOs

Info

ID:	423280
PubChem CID:	135119229
Reduced:	SO2N4C18H26 (1)
Stoich.:	AB2C4D18E26 (1)
Weight, g/mol:	347.165207
ΔH_f, kcal/mol:	-36.56
Dipole, Da:	7.77
IP(EA), eV:	-8.12(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-7-[(6-chloro-2H-chromen-3-yl)methyl]-4-methoxy-7-azaspiro[4.5]decane

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)C(=O)CSC2=CC=CC(=C2)OC

DOS

IR

Vibrations