Geometry & MOs

Info

ID:	17534
PubChem CID:	503464
Reduced:	Cl2N3H17C20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	369.079953
ΔH_f, kcal/mol:	71.15
Dipole, Da:	4.72
IP(EA), eV:	-8.76(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,4-dichlorophenyl)methyl]-3-(imidazol-1-ylmethyl)-2-methylindole

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1CC3=C(C=C(C=C3)Cl)Cl)CN4C=CN=C4

DOS

IR

Vibrations