Geometry & MOs

Info

ID:	194232
PubChem CID:	78502096
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	330.194343
ΔH_f, kcal/mol:	-102.54
Dipole, Da:	5.08
IP(EA), eV:	-8.6(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1-adamantylamino)-1-oxopropan-2-yl] 1-methylpyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=CC=CN2C

DOS

IR

Vibrations