Geometry & MOs

Info

ID:	199502
PubChem CID:	79256568
Reduced:	N3O3C11H19 (1)
Stoich.:	A3B3C11D19 (1)
Weight, g/mol:	268.153541
ΔH_f, kcal/mol:	-149.74
Dipole, Da:	4.42
IP(EA), eV:	-9.67(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[tert-butyl-[methyl(1H-pyrazol-4-ylmethyl)carbamoyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)NCC(=O)NC1CC(=O)N(C1=O)C

DOS

IR

Vibrations