Geometry & MOs

Info

ID:	365795
PubChem CID:	127318520
Reduced:	N3O3C18H23 (1)
Stoich.:	A3B3C18D23 (1)
Weight, g/mol:	394.192629
ΔH_f, kcal/mol:	-78.76
Dipole, Da:	7.67
IP(EA), eV:	-9.11(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-[3-(2-methylpropyl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC(C)CC1COCCN1C(=O)C2=NN(C3=CC=CC=C3C2=O)C

DOS

IR

Vibrations