Geometry & MOs

Info

ID:	363138
PubChem CID:	127310171
Reduced:	O2N4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	338.174276
ΔH_f, kcal/mol:	9.39
Dipole, Da:	6.58
IP(EA), eV:	-9.06(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylindol-3-yl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)C3=NC4=CC=CC=C4C=C3

DOS

IR

Vibrations