Geometry & MOs

Info

ID:	355541
PubChem CID:	127288611
Reduced:	O2N6C17H28 (1)
Stoich.:	A2B6C17D28 (1)
Weight, g/mol:	322.157581
ΔH_f, kcal/mol:	-65.29
Dipole, Da:	3.08
IP(EA), eV:	-9.23(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(1-methyltetrazol-5-yl)methyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(C)C(=O)N3CCN(CC3)C(=O)C

DOS

IR

Vibrations