Geometry & MOs

Info

ID:	364292
PubChem CID:	127315391
Reduced:	N3O3C19H33 (1)
Stoich.:	A3B3C19D33 (1)
Weight, g/mol:	398.108248
ΔH_f, kcal/mol:	-140.85
Dipole, Da:	2.23
IP(EA), eV:	-9.04(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-1-propan-2-ylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCC1OCC(=O)N2CCN(CC2)C(C)C(=O)NC3CC3

DOS

IR

Vibrations