Geometry & MOs

Info

ID:	149457
PubChem CID:	53789130
Reduced:	NO4C23H23 (1)
Stoich.:	AB4C23D23 (1)
Weight, g/mol:	354.113506
ΔH_f, kcal/mol:	-46.53
Dipole, Da:	4.5
IP(EA), eV:	-8.72(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-(2-chlorophenyl)-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]amino]acetate

Drug info:

PubChemData

Smile

C1CC2=C(C1)OC3=C2C=CC(=C3)C(CC(CCC4=CC=CC=C4)C(=O)O)N=O

DOS

IR

Vibrations