Geometry & MOs

Info

ID:	416268
PubChem CID:	135089280
Reduced:	O3N5C22H29 (1)
Stoich.:	A3B5C22D29 (1)
Weight, g/mol:	350.185509
ΔH_f, kcal/mol:	-73.56
Dipole, Da:	3.14
IP(EA), eV:	-9.14(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[methyl-[(1-methylbenzimidazol-2-yl)methyl]amino]pyrazin-2-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=C2C=C(C=C1)C(=O)N3CCC(CC3)CNC(=O)CCC4=CN(CCCO2)N=N4

DOS

IR

Vibrations