Geometry & MOs

Info

ID:	137677
PubChem CID:	52243756
Reduced:	SN4O4C16H22 (1)
Stoich.:	AB4C4D16E22 (1)
Weight, g/mol:	225.092042
ΔH_f, kcal/mol:	-96.94
Dipole, Da:	3.9
IP(EA), eV:	-9.94(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-4-[(3-chlorophenyl)methyl]-3-methylmorpholine

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCCC(=O)NCC2=CC=CC=C2S(=O)(=O)N(C)C

DOS

IR

Vibrations