Geometry & MOs

Info

ID:	323624
PubChem CID:	126675606
Reduced:	N7C19H23 (1)
Stoich.:	A7B19C23 (1)
Weight, g/mol:	501.201219
ΔH_f, kcal/mol:	88.29
Dipole, Da:	2.07
IP(EA), eV:	-8.23(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(1-cyanocyclopropyl)carbamoyl]cyclohexyl]-3-[4-(3-hydroxyoxetan-3-yl)phenyl]furo[2,3-b]pyrazine-6-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=CC(=C(C=C2)N)N(CC3=CC(=NC(=C3N)N)N)N

DOS

IR

Vibrations