Geometry & MOs

Info

ID:	237821
PubChem CID:	92721786
Reduced:	NOC8H11 (3)
Stoich.:	ABC8D11 (3)
Weight, g/mol:	465.299142
ΔH_f, kcal/mol:	-123.36
Dipole, Da:	0.86
IP(EA), eV:	-8.42(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-cyclohexyl-2-[(1R,2S,3S)-2,3-dimethylcyclohexyl]-7-methoxy-3-methyl-1-oxo-4H-pyrazino[1,2-a]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](C)N1C(=O)C2=CC3=C(N2C[C@@]1(C)C(=O)NC4CCCCC4)C=C(C=C3)OC

DOS

IR

Vibrations