Geometry & MOs

Info

ID:	75409
PubChem CID:	48423439
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	302.13789
ΔH_f, kcal/mol:	-98.73
Dipole, Da:	2.27
IP(EA), eV:	-9.5(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(1-methylpyrazol-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NCC(C1=CC=CC=C1)OC)OCC2CC2

DOS

IR

Vibrations