Geometry & MOs

Info

ID:	369398
PubChem CID:	127333024
Reduced:	N3O4C18H27 (1)
Stoich.:	A3B4C18D27 (1)
Weight, g/mol:	358.225643
ΔH_f, kcal/mol:	-201.95
Dipole, Da:	7.13
IP(EA), eV:	-9.61(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone

Drug info:

PubChemData

Smile

CC1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)N3C4CCC3CC(C4)O

DOS

IR

Vibrations