Geometry & MOs

Info

ID:	169984
PubChem CID:	75176507
Reduced:	O2N5H19C24 (1)
Stoich.:	A2B5C19D24 (1)
Weight, g/mol:	502.203862
ΔH_f, kcal/mol:	56.04
Dipole, Da:	6.63
IP(EA), eV:	-9.28(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-benzimidazol-2-ylsulfanyl)-N-[[4-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]methylideneamino]acetamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N[C@@H](C1=O)NC(=O)NC3=CC=CC(=C3)C#N)C4=CC=CC=C4

DOS

IR

Vibrations