Geometry & MOs

Info

ID:	75805
PubChem CID:	48424006
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	299.163377
ΔH_f, kcal/mol:	-21.84
Dipole, Da:	6.94
IP(EA), eV:	-9.38(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[2-(pyrazol-1-ylmethyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N(CC1=NC=CN1C)C2CC2)OCC3CC3

DOS

IR

Vibrations