Geometry & MOs

Info

ID:	363273
PubChem CID:	127310414
Reduced:	N2O3C23H26 (1)
Stoich.:	A2B3C23D26 (1)
Weight, g/mol:	368.108916
ΔH_f, kcal/mol:	-97.7
Dipole, Da:	7.58
IP(EA), eV:	-8.96(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CC1CC(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4O

DOS

IR

Vibrations