Geometry & MOs

Info

ID:	237574
PubChem CID:	92719793
Reduced:	O3N4C26H38 (1)
Stoich.:	A3B4C26D38 (1)
Weight, g/mol:	413.231456
ΔH_f, kcal/mol:	-105.02
Dipole, Da:	3.64
IP(EA), eV:	-8.61(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-cycloheptyl-6-(furan-2-yl)-2-(2-methoxyethyl)-3-methyl-1-oxo-4H-pyrrolo[1,2-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCN(CC)CCN1C(=O)C2=CC=C(N2C[C@@]1(C)C(=O)NC3CCCC3)C4=CC=CO4

DOS

IR

Vibrations