Geometry & MOs

Info

ID:	269421
PubChem CID:	103617409
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	278.120132
ΔH_f, kcal/mol:	-83.87
Dipole, Da:	3.95
IP(EA), eV:	-8.5(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-3-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methylamino]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CNCC(C)(C)C(=O)N)OC

DOS

IR

Vibrations