Geometry & MOs

Info

ID:	362005
PubChem CID:	127305351
Reduced:	O2N7C11H15 (1)
Stoich.:	A2B7C11D15 (1)
Weight, g/mol:	359.103669
ΔH_f, kcal/mol:	45.98
Dipole, Da:	2.95
IP(EA), eV:	-9.61(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloro-3-methyl-1-benzofuran-2-yl)-[2-(pyrazol-1-ylmethyl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CN2C=NN=N2)CN3C=CC=N3

DOS

IR

Vibrations