Geometry & MOs

Info

ID:	74040
PubChem CID:	48421384
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	361.175004
ΔH_f, kcal/mol:	-68.95
Dipole, Da:	4.05
IP(EA), eV:	-9.42(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[(2-hydroxy-3-phenylmethoxypropyl)-methylcarbamoyl]amino]pyrazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CN(CC(COCC1=CC=CC=C1)O)C(=O)NC2=CC=CC=N2

DOS

IR

Vibrations