Geometry & MOs

Info

ID:	235777
PubChem CID:	92710601
Reduced:	SN4O5C25H28 (1)
Stoich.:	AB4C5D25E28 (1)
Weight, g/mol:	476.172956
ΔH_f, kcal/mol:	-152.29
Dipole, Da:	7.23
IP(EA), eV:	-8.41(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-acetyl-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-5-morpholin-4-ylsulfonyl-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1[C@@H](CC2=C1C=CC(=C2)S(=O)(=O)N3CCOCC3)C(=O)NCCC4=CNC5=CC=CC=C54

DOS

IR

Vibrations