Geometry & MOs

Info

ID:	271158
PubChem CID:	103645709
Reduced:	O3N4C15H22 (1)
Stoich.:	A3B4C15D22 (1)
Weight, g/mol:	302.174276
ΔH_f, kcal/mol:	-116.61
Dipole, Da:	5.67
IP(EA), eV:	-8.25(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(2-methyl-3H-benzimidazol-5-yl)amino]azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(C1)NC2=CC=C(C=C2)NC(=O)N

DOS

IR

Vibrations