Geometry & MOs

Info

ID:	302515
PubChem CID:	124365626
Reduced:	O4N5C17H23 (1)
Stoich.:	A4B5C17D23 (1)
Weight, g/mol:	361.175004
ΔH_f, kcal/mol:	-150.35
Dipole, Da:	3.5
IP(EA), eV:	-8.99(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3aR,6aR)-2,5-dioxo-3,3a,6,6a-tetrahydro-1H-imidazo[4,5-d]imidazol-4-yl]-N-[(1S)-1-(4-methoxyphenyl)propyl]propanamide

Drug info:

PubChemData

Smile

CC[C@@H](C1=CC=C(C=C1)OC)NC(=O)CCN2[C@H]3[C@H](NC(=O)N3)NC2=O

DOS

IR

Vibrations