Geometry & MOs

Info

ID:	364605
PubChem CID:	127315857
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	-103.33
Dipole, Da:	3.1
IP(EA), eV:	-8.96(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-dimethylpyrazol-4-yl)-(2-methylmorpholin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)C2COC3=CC=CC=C23

DOS

IR

Vibrations