Geometry & MOs

Info

ID:	344373
PubChem CID:	127267549
Reduced:	ON3C18H23 (1)
Stoich.:	AB3C18D23 (1)
Weight, g/mol:	330.194343
ΔH_f, kcal/mol:	7.51
Dipole, Da:	0.86
IP(EA), eV:	-9.21(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(2-methyl-2-phenylmorpholine-4-carbonyl)azepan-2-one

Drug info:

PubChemData

Smile

CC1=CN(C=N1)C(C)(C)C(=O)NCC2(CC2)C3=CC=CC=C3

DOS

IR

Vibrations