Geometry & MOs

Info

ID:	335476
PubChem CID:	127254338
Reduced:	ClN6O9C26H37 (1)
Stoich.:	AB6C9D26E37 (1)
Weight, g/mol:	320.188863
ΔH_f, kcal/mol:	-342.72
Dipole, Da:	3.12
IP(EA), eV:	-8.41(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzhydryl-N-(cyclopropylmethyl)azetidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(N=C1N3CCN(CC3)CC(CO)O)N(C(=O)N(C2=O)CCOC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C.Cl

DOS

IR

Vibrations