Geometry & MOs

Info

ID:	449055
PubChem CID:	135295617
Reduced:	N4H26C39 (1)
Stoich.:	A4B26C39 (1)
Weight, g/mol:	440.213364
ΔH_f, kcal/mol:	215.02
Dipole, Da:	5.1
IP(EA), eV:	-8.4(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-carbazol-9-yl-2-hydroxypropyl)-N-[(Z,3E)-3-ethylidene-2-methylhex-4-enyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1CC(=CC(=C1)C2=CC(=CC(=C2)C#N)N3C4=C(C=C(C=C4)C#N)C5=CC=CC=C53)N6C7=CC=CC=C7C8=CC=CC=C86

DOS

IR

Vibrations