Geometry & MOs

Info

ID:	353489
PubChem CID:	127285057
Reduced:	SO2N3C19H31 (1)
Stoich.:	AB2C3D19E31 (1)
Weight, g/mol:	373.236542
ΔH_f, kcal/mol:	-98.7
Dipole, Da:	2.94
IP(EA), eV:	-8.85(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-morpholin-4-yl-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C(C)(C)C)C(=O)NCC2(CCOCC2)N3CCCC3

DOS

IR

Vibrations