Geometry & MOs

Info

ID:	195112
PubChem CID:	78636053
Reduced:	FN3O3C19H24 (1)
Stoich.:	AB3C3D19E24 (1)
Weight, g/mol:	302.141262
ΔH_f, kcal/mol:	-148.12
Dipole, Da:	1.73
IP(EA), eV:	-9.49(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[(4-oxo-1,3-diazinan-2-yl)sulfanyl]acetyl]amino]-N-propylpropanamide

Drug info:

PubChemData

Smile

CC1CCCCC1N2C(=O)C(=O)N(C2=O)CN(C)CC3=CC(=CC=C3)F

DOS

IR

Vibrations