Geometry & MOs

Info

ID:	240617
PubChem CID:	93616780
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	263.163377
ΔH_f, kcal/mol:	-96.26
Dipole, Da:	4.66
IP(EA), eV:	-8.84(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-[[(2R)-3-methylbutan-2-yl]carbamoylamino]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)N[C@@H](C)C(C)C)C(=O)N

DOS

IR

Vibrations