Geometry & MOs

Info

ID:	263789
PubChem CID:	103398356
Reduced:	O2N3C14H27 (1)
Stoich.:	A2B3C14D27 (1)
Weight, g/mol:	226.179361
ΔH_f, kcal/mol:	-119.5
Dipole, Da:	2.0
IP(EA), eV:	-8.89(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-tert-butyltriazol-4-yl)methyl]-1-methoxypropan-2-amine

Drug info:

PubChemData

Smile

CCC(C)(C)NC1=NCCN(C1)C(=O)OC(C)(C)C

DOS

IR

Vibrations