Geometry & MOs

Info

ID:	75260
PubChem CID:	48423251
Reduced:	N2O2C19H28 (1)
Stoich.:	A2B2C19D28 (1)
Weight, g/mol:	252.158626
ΔH_f, kcal/mol:	-67.63
Dipole, Da:	3.88
IP(EA), eV:	-8.62(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[3-(1,2,4-triazol-1-yl)propyl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC(=C1)CN2CCCCC2)OCC3CC3

DOS

IR

Vibrations