Geometry & MOs

Info

ID:	331210
PubChem CID:	127248617
Reduced:	O2N4C27H34 (1)
Stoich.:	A2B4C27D34 (1)
Weight, g/mol:	438.237939
ΔH_f, kcal/mol:	-2.79
Dipole, Da:	2.15
IP(EA), eV:	-8.02(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,5-dimethylpyrazol-4-yl)-2-[2-[1-methyl-5-(2-phenoxyethyl)pyrazol-3-yl]morpholin-4-yl]acetamide

Drug info:

PubChemData

Smile

CCN1CCC2=C1C=CC(=C2)CN3CCOC(C3)C4=NN(C(=C4)CCOC5=CC=CC=C5)C

DOS

IR

Vibrations