Geometry & MOs

Info

ID:	302514
PubChem CID:	124365623
Reduced:	SN2O4C23H30 (1)
Stoich.:	AB2C4D23E30 (1)
Weight, g/mol:	361.175004
ΔH_f, kcal/mol:	-141.36
Dipole, Da:	6.12
IP(EA), eV:	-8.74(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3aS,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](C)S(=O)(=O)N1CCNC(=O)[C@H](C1)CC2=CC=CC=C2C3=CC=C(C=C3)OC

DOS

IR

Vibrations