Geometry & MOs

Info

ID:	353724
PubChem CID:	127285301
Reduced:	ClN2O2C17H23 (1)
Stoich.:	AB2C2D17E23 (1)
Weight, g/mol:	277.109423
ΔH_f, kcal/mol:	-80.56
Dipole, Da:	2.55
IP(EA), eV:	-9.55(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-N-[(1-methyltetrazol-5-yl)methyl]cyclobutan-1-amine

Drug info:

PubChemData

Smile

C1CC(C1)(C2=CC=C(C=C2)Cl)NCC(=O)NC3CCOCC3

DOS

IR

Vibrations