Geometry & MOs

Info

ID:	243135
PubChem CID:	99215901
Reduced:	O3N4C25H32 (1)
Stoich.:	A3B4C25D32 (1)
Weight, g/mol:	450.208947
ΔH_f, kcal/mol:	-61.81
Dipole, Da:	4.94
IP(EA), eV:	-8.24(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-N-[[2-(diethylaminomethyl)phenyl]methyl]-3-(1H-indole-3-carbonyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=CC=C(C=C3)CNC(=O)C=C

DOS

IR

Vibrations