Geometry & MOs

Info

ID:	347563
PubChem CID:	127272418
Reduced:	ON4C17H22 (1)
Stoich.:	AB4C17D22 (1)
Weight, g/mol:	284.174945
ΔH_f, kcal/mol:	61.64
Dipole, Da:	2.99
IP(EA), eV:	-8.39(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-cyclopropyltetrazol-5-yl)methyl]-N-phenylpyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C2CC2)N3CCC(C3)NC4=CC=CC=C4

DOS

IR

Vibrations