Geometry & MOs

Info

ID:	237575
PubChem CID:	92719796
Reduced:	N3O4C23H31 (1)
Stoich.:	A3B4C23D31 (1)
Weight, g/mol:	451.283492
ΔH_f, kcal/mol:	-128.21
Dipole, Da:	2.97
IP(EA), eV:	-8.68(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@]1(CN2C(=CC=C2C(=O)N1CCOC)C3=CC=CO3)C(=O)NC4CCCCCC4

DOS

IR

Vibrations