Geometry & MOs

Info

ID:	266137
PubChem CID:	103558498
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	297.187484
ΔH_f, kcal/mol:	-66.19
Dipole, Da:	3.67
IP(EA), eV:	-9.76(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[5-[(1-methoxycyclobutyl)methyl]-1,3,4-thiadiazol-2-yl]propyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

COC1(CCC1)CC(C(CN)C2=CN=CC=C2)O

DOS

IR

Vibrations