Geometry & MOs

Info

ID:	422283
PubChem CID:	135117555
Reduced:	SO3N4C20H22 (1)
Stoich.:	AB3C4D20E22 (1)
Weight, g/mol:	294.205576
ΔH_f, kcal/mol:	-36.17
Dipole, Da:	5.25
IP(EA), eV:	-9.36(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-morpholin-4-yl-N-[(1-propylimidazol-2-yl)methyl]butanamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CC(=O)N2CCCN(CC2)C(=O)C3=CC4=C(C=C3)SC(=N4)C

DOS

IR

Vibrations