Geometry & MOs

Info

ID:	152697
PubChem CID:	56311731
Reduced:	SO2N4C26H26 (1)
Stoich.:	AB2C4D26E26 (1)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	4.53
Dipole, Da:	7.23
IP(EA), eV:	-8.3(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]methyl]carbamate

Drug info:

PubChemData

Smile

C1CN(CCC1C2=CC3=CC=CC=C3N2)CC(=O)NC4=CC=C(C=C4)NC(=O)C5=CC=CS5

DOS

IR

Vibrations