Geometry & MOs

Info

ID:	397584
PubChem CID:	135030423
Reduced:	N2O3C24H28 (1)
Stoich.:	A2B3C24D28 (1)
Weight, g/mol:	402.2341
ΔH_f, kcal/mol:	-115.0
Dipole, Da:	2.3
IP(EA), eV:	-8.74(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylpropanoyl)-N-pentylspiro[2H-indole-3,4'-thiane]-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C(C23CCOCC3)C(=O)NC4=C(C=CC=C4C)C)C(=O)C

DOS

IR

Vibrations