Geometry & MOs

Info

ID:	175079
PubChem CID:	75852483
Reduced:	N3O3C23H37 (1)
Stoich.:	A3B3C23D37 (1)
Weight, g/mol:	407.253255
ΔH_f, kcal/mol:	-137.69
Dipole, Da:	4.25
IP(EA), eV:	-8.72(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-amino-1-butyl-2,4-dioxo-1,3-diazinan-5-yl)-N-butyl-1-cyclopropyl-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1CC(CN(C1)CCCNC(=O)C(C(C)C)NC(=O)COC2=CC=CC=C2)C

DOS

IR

Vibrations