Geometry & MOs

Info

ID:	311512
PubChem CID:	126592985
Reduced:	N4O6C19H28 (1)
Stoich.:	A4B6C19D28 (1)
Weight, g/mol:	378.226705
ΔH_f, kcal/mol:	-182.17
Dipole, Da:	4.93
IP(EA), eV:	-9.74(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(5-aminopyridin-2-yl)-N-[[1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropyl]methyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1(CC1)CN(C2=NC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)(C)C

DOS

IR

Vibrations