Geometry & MOs

Info

ID:	28296
PubChem CID:	826870
Reduced:	ClNOC13H14 (1)
Stoich.:	ABCD13E14 (1)
Weight, g/mol:	337.215413
ΔH_f, kcal/mol:	-22.65
Dipole, Da:	5.26
IP(EA), eV:	-9.03(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,12R)-N,N,6,7,12,15,15-heptamethyl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)N2CCC(=CCl)C2=O

DOS

IR

Vibrations