Geometry & MOs

Info

ID:	74466
PubChem CID:	48421918
Reduced:	N3O3C16H25 (1)
Stoich.:	A3B3C16D25 (1)
Weight, g/mol:	321.168856
ΔH_f, kcal/mol:	-55.49
Dipole, Da:	4.61
IP(EA), eV:	-9.27(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-1-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CN2CCN(CC2)C(=O)C(C)OCC3CC3

DOS

IR

Vibrations