Geometry & MOs

Info

ID:	345672
PubChem CID:	127269972
Reduced:	SO2N6C16H16 (1)
Stoich.:	AB2C6D16E16 (1)
Weight, g/mol:	239.188529
ΔH_f, kcal/mol:	18.61
Dipole, Da:	4.99
IP(EA), eV:	-9.07(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cycloheptyl-(2,5-dimethylmorpholin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=NN=C2N1C=C(C=C2)C(=O)N3CCCC3C(=O)NC4=NC=CS4

DOS

IR

Vibrations