Geometry & MOs

Info

ID:	73593
PubChem CID:	48418412
Reduced:	N3O4C22H29 (1)
Stoich.:	A3B4C22D29 (1)
Weight, g/mol:	399.136511
ΔH_f, kcal/mol:	-100.75
Dipole, Da:	3.7
IP(EA), eV:	-8.7(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(1-methylindol-3-yl)acetyl]-2-morpholin-4-yl-1,3-thiazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)CN(C)CC2=CC=CC=C2)OC

DOS

IR

Vibrations