Geometry & MOs

Info

ID:	181869
PubChem CID:	76807278
Reduced:	O4N5C26H31 (1)
Stoich.:	A4B5C26D31 (1)
Weight, g/mol:	491.242021
ΔH_f, kcal/mol:	-101.69
Dipole, Da:	2.02
IP(EA), eV:	-9.29(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[5-[[1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-4,5-dimethylfuran-2-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C(C1CCCCC1)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)CNC(=O)C4=CN=CN4C

DOS

IR

Vibrations