Geometry & MOs

Info

ID:	190224
PubChem CID:	77971455
Reduced:	O3N5C32H33 (1)
Stoich.:	A3B5C32D33 (1)
Weight, g/mol:	447.252192
ΔH_f, kcal/mol:	75.9
Dipole, Da:	9.19
IP(EA), eV:	-8.78(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(cyclopentylamino)methyl]-4-methyl-1H-indol-5-yl]-4-(oxolan-2-ylmethoxy)benzamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C=C(C2C1C=CC=C2)C3=C4C=C(C5C=CC(=CC5=C4C(=O)N=C3)C6=CNN=C6)CCCN

DOS

IR

Vibrations