Geometry & MOs

Info

ID:	305878
PubChem CID:	124972417
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	289.153875
ΔH_f, kcal/mol:	-22.19
Dipole, Da:	3.28
IP(EA), eV:	-8.93(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-ethylpyrazol-4-yl)-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN=C(N1)[C@H]2CN(CCO2)C(=O)CN(C)CC3=CN=CC=C3

DOS

IR

Vibrations