Geometry & MOs

Info

ID:	127193
PubChem CID:	50994054
Reduced:	FN2O2H19C24 (1)
Stoich.:	AB2C2D19E24 (1)
Weight, g/mol:	372.216141
ΔH_f, kcal/mol:	-30.31
Dipole, Da:	5.07
IP(EA), eV:	-8.92(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2S)-1-[[cyano(methyl)amino]-methylamino]-3-cyclohexyl-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)C(=O)C(=O)C2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)F

DOS

IR

Vibrations