Geometry & MOs

Info

ID:	71017
PubChem CID:	48414184
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-88.3
Dipole, Da:	7.55
IP(EA), eV:	-9.44(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methoxyphenyl)methoxy]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCC3=C(NN=C3)C

DOS

IR

Vibrations