Geometry & MOs

Info

ID:	361996
PubChem CID:	127305342
Reduced:	O2N5C14H19 (1)
Stoich.:	A2B5C14D19 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-3.51
Dipole, Da:	3.73
IP(EA), eV:	-9.3(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-morpholin-4-ylphenyl)-[2-(pyrazol-1-ylmethyl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=NN1C)C(=O)N2CCOC(C2)CN3C=CC=N3

DOS

IR

Vibrations