Geometry & MOs

Info

ID:	416887
PubChem CID:	135090677
Reduced:	ON6C15H20 (1)
Stoich.:	AB6C15D20 (1)
Weight, g/mol:	237.147727
ΔH_f, kcal/mol:	56.12
Dipole, Da:	6.22
IP(EA), eV:	-9.0(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

CCN(CCN1C=CC=N1)CC2=CC(=O)N3C(=N2)C=C(N3)C

DOS

IR

Vibrations