Geometry & MOs

Info

ID:	322370
PubChem CID:	126669932
Reduced:	ClON6C19H27 (1)
Stoich.:	ABC6D19E27 (1)
Weight, g/mol:	368.150285
ΔH_f, kcal/mol:	20.95
Dipole, Da:	2.82
IP(EA), eV:	-8.51(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 5-[(4-chlorophenyl)methyl]-2-(methylcarbamoyl)morpholine-4-carboxylate

Drug info:

PubChemData

Smile

CC1CN([C@H](CO1)CC2=CC=C(C=C2)Cl)C3CCN(CC3)C4=NNC(=N4)N

DOS

IR

Vibrations