Geometry & MOs

Info

ID:	415181
PubChem CID:	135088172
Reduced:	ClNO3C18H24 (1)
Stoich.:	ABC3D18E24 (1)
Weight, g/mol:	394.192629
ΔH_f, kcal/mol:	-126.16
Dipole, Da:	4.61
IP(EA), eV:	-9.27(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-2-oxoethyl]-N-(3-methylphenyl)methanesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)CN2CC[C@H]([C@@](C2)(CC3CC3)C(=O)O)O

DOS

IR

Vibrations