Geometry & MOs

Info

ID:	14654
PubChem CID:	417034
Reduced:	O2S2N6C23H26 (1)
Stoich.:	A2B2C6D23E26 (1)
Weight, g/mol:	482.155866
ΔH_f, kcal/mol:	16.3
Dipole, Da:	4.65
IP(EA), eV:	-8.84(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[4-(4,5-dihydro-1H-imidazol-2-yl)anilino]-2-oxoethyl]sulfanylmethylsulfanyl]-N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1CN=C(N1)C2=CC=C(C=C2)NC(=O)CSCSCC(=O)NC3=CC=C(C=C3)C4=NCCN4

DOS

IR

Vibrations