Geometry & MOs

Info

ID:	169670
PubChem CID:	75135149
Reduced:	SN5O5C19H29 (1)
Stoich.:	AB5C5D19E29 (1)
Weight, g/mol:	389.195071
ΔH_f, kcal/mol:	-214.86
Dipole, Da:	7.92
IP(EA), eV:	-9.61(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]-6-methyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1C(C(=O)NC(=O)N1)CCC(=O)N(C)CC2=C(N(N=C2C)C3CCS(=O)(=O)C3)C

DOS

IR

Vibrations