Geometry & MOs

Info

ID:	305833
PubChem CID:	124971195
Reduced:	SO3N4C16H24 (1)
Stoich.:	AB3C4D16E24 (1)
Weight, g/mol:	344.148455
ΔH_f, kcal/mol:	-107.59
Dipole, Da:	6.1
IP(EA), eV:	-9.48(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-acetyl-4-(4-methoxy-1H-indole-2-carbonyl)piperazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NCC1=NC(=CC=C1)[C@@H]2CCCN2S(=O)(=O)N3CCCC3

DOS

IR

Vibrations