Geometry & MOs

Info

ID:	217192
PubChem CID:	85087403
Reduced:	NO5C18H31 (1)
Stoich.:	AB5C18D31 (1)
Weight, g/mol:	341.14495
ΔH_f, kcal/mol:	-158.0
Dipole, Da:	2.06
IP(EA), eV:	-9.18(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-1-phenyl-13-thia-3-azatetracyclo[9.3.1.03,12.07,12]pentadecane-2,14-dione

Drug info:

PubChemData

Smile

CC1CCC2C(C(OC3C24C1CCC(O3)(OO4)C)OCCCN)C

DOS

IR

Vibrations