Geometry & MOs

Info

ID:	150522
PubChem CID:	53790215
Reduced:	ClON6C26H27 (1)
Stoich.:	ABC6D26E27 (1)
Weight, g/mol:	368.158375
ΔH_f, kcal/mol:	45.82
Dipole, Da:	2.67
IP(EA), eV:	-8.73(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCN(CC3=CC=C(C=C3)Cl)C4=CC=CC=N4

DOS

IR

Vibrations